SCHEMBL4152216

SCHEMBL4152216

CC(=O)Oc1c(-c2ccccc2)oc2cc(O)c(C(C)=O)c(OC(C)=O)c2c1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 4/20 0.64
ABCB1 P08183 3/20 0.53
CREB1 P16220 1/20 0.53
KDM4E B2RXH2 6/20 0.49
MAPT P10636 5/20 0.49
ALDH1A1 P00352 4/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
MEN1 O00255 7/20 0.47
KMT2A Q03164 7/20 0.47
CYP3A4 P08684 4/20 0.47
CYP2C9 P11712 2/20 0.47
MAPK1 P28482 2/20 0.47
HSD17B10 Q99714 2/20 0.47
HTT P42858 2/20 0.44
LMNA P02545 2/20 0.44
GAA P10253 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
XDH P47989 2/20 0.44
TUBB4A P04350 1/20 0.44

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4173907 0.91 CYP3A4 (0.54) ADORA3ABCB1KDM4EMAPTALDH1A1
SCHEMBL28428273 0.89 ADORA3 (0.67) ADORA3ABCB1CREB1KDM4EMAPT
SCHEMBL4157325 0.83 ABCB1 (0.76) ADORA3ABCB1KDM4EMAPTALDH1A1
SCHEMBL28421208 0.82 ADORA3 (0.74) ADORA3ABCB1CREB1KDM4EMAPT
SCHEMBL4160600 0.81 ADORA3 (0.52) ADORA3ABCB1CREB1KDM4EMAPT
SCHEMBL4156024 0.81 ADORA3 (0.56) ADORA3ABCB1KDM4EMAPTALDH1A1
SCHEMBL28410849 0.80 ADORA3 (0.79) ADORA3ABCB1CREB1KDM4EMAPT
SCHEMBL28417080 0.79 ADORA3 (0.70) ADORA3ABCB1CREB1KDM4EMAPT
SCHEMBL1664667 0.78 ADORA3 (1.00) ADORA3ABCB1CREB1KDM4EMAPT
SCHEMBL4169488 0.77 ADORA3 (0.48) ADORA3ABCB1MAPTALDH1A1MEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090130051-A1 Flavonoid Compounds and Uses Thereof HOWARD FLOREY INSTITUTE OF EXPERIMENTAL PHYSIOLOGY AND MEDICINE (AU) 2009-05-21 US claimed
CN-107801402-B Composition for diagnosing skin damage caused by mote and composition comprising galangin as effective ingredient 株式会社爱茉莉太平洋 2022-03-11 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090130051-A1 Flavonoid Compounds and Uses Thereof CAT, NQO1, GPX4 ADORA3 2776/4885ABCB1 1605/4885CREB1 3943/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.